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Isbufylline

Isbufylline structure

CAS No:
90162-60-0
Formula:
C11H16N4O2
Chemical Name:
Isbufylline
Synonyms:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(2-methylpropyl)-;3,7-Dihydro-1,3-dimethyl-7-(2-methylpropyl)-1H-purine-2,6-dione;1,3-Dimethyl-7-isobutylxanthine;Isbufylline;7-Isobutyl-1,3-dimethylxanthine;1,3-Dimethyl-7-(2-methylpropyl)purine-2,6-dione;1,3-Dimethyl-7-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

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Isbufylline Basic Attributes

Molecular Weight：

236.275

Exact Mass：

236.27

UNII：

9C8Z5F38D0

DSSTox ID：

DTXSID6046767

Characteristics

PSA：

58.4

XLogP3：

0.08970

Density：

1.3g/cm3

Boiling Point：

425ºC at 760 mmHg

Flash Point：

210.8ºC

Refractive Index：

1.625

Water Solubility：

>35.4 [ug/mL]

Drug Information

MeSH Entry Terms：

1,3-dimethyl-7-isobutylxanthine

Computed Properties

Molecular Weight:236.27
XLogP3:0.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:236.12732577
Monoisotopic Mass:236.12732577
Topological Polar Surface Area:58.4
Heavy Atom Count:17
Complexity:344
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Isbufylline

Basic Attributes
Characteristics
Drug Information
Computed Properties

Isbufylline

SDS

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